Dataset

4,4`-Oxydianiline

This MassBank record with Accession MSBNK-Eawag-EQ01107201 contains the MS2 mass spectrum of 4,4`-Oxydianiline with the InChIkey HLBLWEWZXPIGSM-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H12N2O/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2
SMILES NC1=CC=C(OC2=CC=C(N)C=C2)C=C1
InChI Key HLBLWEWZXPIGSM-UHFFFAOYSA-N
Molecular Formula C12H12N2O
Exact Mass 200.095 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01107201
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:59:30.052179
MetadataModified 2025-02-09T09:59:30.225685
MetadataPublished 2024-06-14
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
7579 PubChem
15092193 PubChem: Thomson Pharma
SCHEMBL41849 SureChEMBL
28DLB4Z70T FDA SRS
101-80-4 ACToR
491566 eMolecules
CB1689134 ChemicalBook
MCULE-1839823867 Mcule
CHEMBL354663 ChEMBL
C14759 KEGG Ligand
34384 ChEBI
DTXSID0021094 EPA CompTox Dashboard
SUCVER CCDC
J38.182I Nikkaji
ZINC000000260472 ZINC
The data in this table is sourced from UniChem at EBI.